AD60784
2143-88-6 | 1-(4-Methylphenyl)-4-nitrobenzene
Manufacturer: A2B Chem
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CatalogNumber
AD60784
ChemicalName
1-(4-Methylphenyl)-4-nitrobenzene
CasNumber
2143-88-6
MolecularFormula
C13H11NO2
MolecularWeight
213.2319
MdlNumber
MFCD00452735
Smiles
Cc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]
Complexity
233
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
4
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CatalogNumber: AD60784
ChemicalName: 1-(4-Methylphenyl)-4-nitrobenzene
CasNumber: 2143-88-6
MolecularFormula: C13H11NO2
MolecularWeight: 213.2319
MdlNumber: MFCD00452735
Smiles: Cc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]
Complexity: 233
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 4
CatalogNumber:
AD60784
ChemicalName:
1-(4-Methylphenyl)-4-nitrobenzene
CasNumber:
2143-88-6
MolecularFormula:
C13H11NO2
MolecularWeight:
213.2319
MdlNumber:
MFCD00452735
Smiles:
Cc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]
Complexity:
233
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
4
CatalogNumber: AD60785
ChemicalName: (3E)-4-(2-Fluorophenyl)but-3-en-2-one
CasNumber: 2143-80-8
MolecularFormula: C10H9FO
MolecularWeight: 164.1763
MdlNumber: MFCD01221416
Smiles: CC(=O)/C=C/c1ccccc1F
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AD60785
ChemicalName:
(3E)-4-(2-Fluorophenyl)but-3-en-2-one
CasNumber:
2143-80-8
MolecularFormula:
C10H9FO
MolecularWeight:
164.1763
MdlNumber:
MFCD01221416
Smiles:
CC(=O)/C=C/c1ccccc1F
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: NC(=O)CCI
Complexity: __
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HydrogenBondAcceptorCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
NC(=O)CCI
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AD60787
ChemicalName: 2,4-Dimethoxyphenylboronic acid, pinacol ester
CasNumber: 214360-69-7
MolecularFormula: C14H21BO4
MolecularWeight: 264.1251
MdlNumber: MFCD06795688
Smiles: COc1cc(OC)ccc1B1OC(C(O1)(C)C)(C)C
Complexity: 303
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AD60787
ChemicalName:
2,4-Dimethoxyphenylboronic acid, pinacol ester
CasNumber:
214360-69-7
MolecularFormula:
C14H21BO4
MolecularWeight:
264.1251
MdlNumber:
MFCD06795688
Smiles:
COc1cc(OC)ccc1B1OC(C(O1)(C)C)(C)C
Complexity:
303
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
__